Vitas-M small molecule compound
4-(4-oxoquinazolin-3(4H)-yl)-N-[(2Z)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STK932976
SMILES O=C(/N=c\1/[nH]nc(s1)CCc1ccccc1)CCCn1cnc2c(c1=O)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H21N5O2S MW 419.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O2S/c28-19(11-6-14-27-15-23-18-10-5-4-9-17(18)21(27)29)24-22-26-25-20(30-22)13-12-16-7-2-1-3-8-16/h1-5,7-10,15H,6,11-14H2,(H,24,26,28)InChIKey
JXDYLYFYYUJUHG-UHFFFAOYSA-NSynonyms
1219562-42-11219562421
4(4oxoquinazolin3(4H)yl)N((2Z)5(2phenylethyl)134thiadiazol2(3H)ylidene)butanamide
4(4oxoquinazolin3yl)N(5(2phenylethyl)134thiadiazol2yl)butanamide
C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O
InChI=1SC22H21N5O2Sc2819(11614271523181054917(18)21(27)29)2422262520(3022)1312167213816h1571015H61114H2(H242628)
MFCD18177392
O=C(N=c1(nH)nc(s1)CCc1ccccc1)CCCn1cnc2c(c1=O)cccc2
ZINC000040287978
ZINC40287978
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